PUBCHEM-ZINC05980441 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 0.4640 1.5850 -0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 0.0580 -0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -0.4920 -1.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -1.8470 -1.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 -2.4490 -2.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -3.8260 -2.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -4.6050 -1.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -4.0080 -0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 -2.6310 -0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -6.1070 -1.8740 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0310 -6.6100 -2.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -7.4680 -1.7880 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9160 -8.1400 -2.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5160 -8.9050 -1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 -8.9680 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -8.2590 0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -7.5000 -0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -6.7280 -0.5610 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -6.5720 0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 -6.0160 1.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 -5.8640 2.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -6.2640 2.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9280 -6.8190 1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1090 -6.9790 0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 -6.5400 -2.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 1.9020 -0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 1.9380 -1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 2.0050 0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 -0.2940 0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 -0.2580 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 -1.8410 -3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 -4.2950 -3.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.6180 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.1650 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -5.7710 -3.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -7.1890 -3.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 -8.0870 -3.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4260 -9.4460 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -9.5580 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -8.2890 1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -5.7020 1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 -5.4300 3.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 -6.1440 3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9600 -7.1310 1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -7.4160 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 -6.1840 -3.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 M CHG 1 12 1 M END